3-cyclopropyl-6-methyl-1-[2-oxidanylidene-2-(propan-2-ylamino)ethyl]pyrazolo[3,4-b]pyridine-4-carboxylic acid

Systemtic Name: 3-cyclopropyl-6-methyl-1-[2-oxidanylidene-2-(propan-2-ylamino)ethyl]pyrazolo[3,4-b]pyridine-4-carboxylic acid Openeye Name: 3-cyclopropyl-1-[2-(isopropylamino)-2-oxo-ethyl]-6-methyl-pyrazolo[3,4-b]pyridine-4-carboxylic acid CAS Name: 3-cyclopropyl-6-methyl-1-[2-oxo-2-(propan-2-ylamino)ethyl]-4-pyrazolo[3,4-b]pyridinecarboxylic acid IUPAC Name: 3-cyclopropyl-6-methyl-1-[2-oxo-2-(propan-2-ylamino)ethyl]pyrazolo[3,4-b]pyridine-4-carboxylic acid Traditional Name: 3-cyclopropyl-1-[2-(isopropylamino)-2-keto-ethyl]-6-methyl-pyrazolo[3,4-b]pyridine-4-carboxylic acid Formula: C16H20N4O3 MolecularWeight: 316.355

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C(=C1)C(=O)O)C(=NN2CC(=O)NC(C)C)C3CC3

Isomeric SMILES

CC1=NC2=C(C(=C1)C(=O)O)C(=NN2CC(=O)NC(C)C)C3CC3

InChI

InChI=1S/C16H20N4O3/c1-8(2)17-12(21)7-20-15-13(14(19-20)10-4-5-10)11(16(22)23)6-9(3)18-15/h6,8,10H,4-5,7H2,1-3H3,(H,17,21)(H,22,23)